Crystallography Open Database

Information card for entry 4339280

Preview

Coordinates	4339280.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C5 H5 N O3 S Zn
Calculated formula	C5 H5 N O3 S Zn
Title of publication	Amine-controlled assembly of metal-sulfite architecture from 1D chains to 3D framework.
Authors of publication	Austria, Cristina; Zhang, Jian; Valle, Henry; Zhang, Qichun; Chew, Emily; Nguyen, Dan-Tam; Gu, J. Y.; Feng, Pingyun; Bu, Xianhui
Journal of publication	Inorganic chemistry
Year of publication	2007
Journal volume	46
Journal issue	16
Pages of publication	6283 - 6290
a	4.9404 ± 0.0003 Å
b	8.782 ± 0.0005 Å
c	17.1114 ± 0.0009 Å
α	90°
β	96.395 ± 0.004°
γ	90°
Cell volume	737.79 ± 0.07 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0627
Residual factor for significantly intense reflections	0.0331
Weighted residual factors for significantly intense reflections	0.076
Weighted residual factors for all reflections included in the refinement	0.0935
Goodness-of-fit parameter for all reflections included in the refinement	1.095
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179495 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/92.	4339280.cif
117248	2014-06-14	cif/ Adding structures of 4339280 via cif-deposit CGI script.	4339280.cif